Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 5/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL476315 | 0.88 | ROCK2 (0.35) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL476368 | 0.86 | PTGDR2 (0.35) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL476255 | 0.85 | PTGDR2 (0.34) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL476410 | 0.83 | PRKAB2 (0.35) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL476251 | 0.82 | PTGDR2 (0.32) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL476189 | 0.81 | CNR1 (0.37) | CNR1CNR2TP53MDM2 | |
| SCHEMBL1848627 | 0.80 | ROCK2 (0.38) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL1850509 | 0.79 | HDAC1 (0.38) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL476455 | 0.78 | PTGDR2 (0.35) | ROCK2HDAC1PTGDR2TACR1CNR1 | |
| SCHEMBL1848299 | 0.77 | EP300 (0.47) | ROCK2HDAC1CNR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2411383-A1 | DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010109150-A1 | DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2010-09-30 | — | — | WO | disclosed |